%chk=000005265.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005265

0 1
 F   -4.495000       3.565300      0.6610000    
 O    3.815100      -2.904700      0.4860000    
 O   -3.952300      -2.679200      0.3893000    
 N    3.237800      0.5702000      6.6900000E-02
 N   8.5199997E-02  -2.245700      0.1187000    
 N    4.965200     -0.8964000      0.3575000    
 C    2.612500     -0.7753000      0.1617000    
 C    1.926800      -1.183900      -1.154600    
 C    1.723900     -0.9098000       1.411500    
 C    1.013400      -2.404600      -1.007200    
 C   0.8241000      -2.149200       1.383200    
 C    3.834900      -1.689100      0.3559000    
 C    4.689300      0.4925000      0.1855000    
 C  -0.8533000      -3.367800      0.1641000    
 C    2.620000       1.800000     -0.1136000    
 C   -1.636900      -3.455200      -1.147100    
 C    3.363600       3.010600     -0.1888000    
 C    1.207600       1.921300     -0.2335000    
 C   -2.443100      -2.184100      -1.427900    
 C    2.742800       4.246700     -0.3702000    
 C   0.5869000       3.157300     -0.4147000    
 C   -3.414700      -1.825700     -0.3124000    
 C    1.354400       4.320100     -0.4833000    
 C   -3.704200     -0.3866000     -5.2700002E-02
 C   -3.641400      0.5008000      -1.104000    
 C   -4.023000      2.9000000E-03   1.229200    
 C   -3.911000       1.847600     -0.8606000    
 C   -4.292400       1.349800       1.472600    
 C   -4.236300       2.272100      0.4276000    
 H    1.328700     -0.3672000      -1.568800    
 H    2.681200      -1.400400      -1.923500    
 H    1.081500     -3.5599999E-02   1.548300    
 H    2.344800     -0.9484000       2.316900    
 H    1.612400      -3.317500     -0.8995000    
 H   0.5016000      -2.474300      -1.970300    
 H   0.1193000      -2.067100       2.220400    
 H    1.419000      -3.053700       1.562200    
 H    5.065700       1.022600       1.066100    
 H    5.201300      0.8280000     -0.7220000    
 H    5.902100      -1.270400      0.4705000    
 H  -0.3234000      -4.316600      0.3218000    
 H   -1.538400      -3.251100       1.010800    
 H   -2.344200      -4.289600      -1.041000    
 H   -1.023700      -3.730300      -2.009900    
 H    4.447900       3.009200     -0.1065000    
 H   0.5521000       1.058000     -0.1908000    
 H   -1.753500      -1.354000      -1.611200    
 H   -3.034200      -2.331000      -2.339500    
 H    3.340000       5.152400     -0.4235000    
 H  -0.4942000       3.215000     -0.5029000    
 H   0.8709000       5.282300     -0.6245000    
 H   -3.410300      0.1942000      -2.118900    
 H   -4.064300     -0.7028000       2.053200    
 H   -3.871400       2.565700      -1.674500    
 H   -4.544400       1.681000       2.475700    


%chk=000005265-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000005265

0 1
F -6.121281 3.424185 0.632883
O 4.081218 -3.060901 0.535350
O -3.799650 -2.552021 0.800903
N 3.554277 0.462830 0.004233
N 0.321116 -2.331424 0.021330
N 5.251480 -1.025711 0.392353
C 2.900615 -0.876796 0.113512
C 2.212930 -1.305183 -1.224962
C 1.927369 -0.962795 1.336007
C 1.307750 -2.543914 -1.070677
C 1.041840 -2.224660 1.318151
C 4.113418 -1.810538 0.372088
C 5.018562 0.399205 0.170397
C -0.746866 -3.367232 0.048342
C 2.937532 1.700929 -0.238503
C -1.783441 -3.188849 -1.085776
C 3.739360 2.883843 -0.327421
C 1.523107 1.850985 -0.403169
C -2.430391 -1.791122 -1.074004
C 3.155280 4.143869 -0.567914
C 0.957289 3.118806 -0.640301
C -3.484146 -1.605864 0.018225
C 1.758616 4.280562 -0.727583
C -4.154814 -0.263971 0.150494
C -3.818959 0.844470 -0.674204
C -5.163292 -0.107338 1.141441
C -4.472892 2.084234 -0.519071
C -5.827875 1.121142 1.312272
C -5.463851 2.190942 0.472855
H 1.605645 -0.464984 -1.600356
H 2.995210 -1.505205 -1.981994
H 1.275273 -0.074346 1.338980
H 2.520596 -0.934569 2.269778
H 1.928304 -3.450344 -0.874490
H 0.767520 -2.704076 -2.021101
H 0.295046 -2.146811 2.130087
H 1.665319 -3.129515 1.510517
H 5.360646 1.008600 1.036287
H 5.552063 0.762437 -0.736234
H 6.177548 -1.422595 0.548395
H -0.319625 -4.399345 -0.005076
H -1.274230 -3.285255 1.015521
H -2.560461 -3.965321 -0.960075
H -1.307145 -3.359149 -2.070178
H 4.825955 2.829961 -0.208832
H 0.856082 0.988323 -0.341637
H -1.623786 -1.042489 -0.923283
H -2.901339 -1.561418 -2.051551
H 3.803545 5.025862 -0.629220
H -0.130847 3.195546 -0.753481
H 1.308030 5.260989 -0.911471
H -3.044618 0.748629 -1.441188
H -5.406693 -0.971980 1.767122
H -4.230138 2.948593 -1.143589
H -6.605798 1.259076 2.068518


